2,4-Difluorophenol - ≥99% , CAS No.367-27-1

CAS: 367-27-1 Cat. No.: D120804 분자식: F₂C₆H₃OH 분자량: 130.09 Beilstein Registry Number: 1934803 EC 번호: 206-688-0

등급 & 순도 ≥99%

Synonyms

Biolf 62|2.4-difluorophenol|Phenol, 2,4-difluoro-|2, 4 difluorophenol|Dacatic|2,4 difluoro phenol|2,4-diflurophenol|VALACYCLOVIR HYDROCHLORIDE [USP-RS]|2,4difluorophenol|2,4-Difluorophenol|2,4-di-fluorophenol|2,4-difluoro-phenol|Didanosinum (INN-Latin)|2,4-difluoro phenol

Storage

Room temperature

Shipped In

Normal

개요

Product Application：

2,4-Difluorophenol has been used:as starting reagent during the synthesis of 4,6-difluoro-5,7-dihydroxytryptamine；in the synthesis of 3-carboxy-6,8-difluoro-7-hydroxycoumarin (Pacific Blue), fluorinated fluorescent dye

사양

동의어

Biolf 62 | 2.4-difluorophenol | Phenol, 2,4-difluoro- | 2, 4 difluorophenol | Dacatic | 2,4 difluoro phenol | 2,4-diflurophenol | VALACYCLOVIR HYDROCHLORIDE [USP-RS] | 2,4difluorophenol | 2,4-Difluorophenol | 2,4-di-fluorophenol | 2,4-difluoro-phenol | Didanosinum (INN-Latin) | 2,4-difluoro phenol

사양 및 순도

≥99%

보관 조건

Room temperature

배송

Normal

순수함

≥99%

이름과 식별자

Pubchem Sid

528755396

정식 스마일

C1=CC(=C(C=C1F)F)O

IUPAC Name

2,4-difluorophenol

InChIKey

NVWVWEWVLBKPSM-UHFFFAOYSA-N

INCHI

1S/C6H4F2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H

이성체 SMILES

C1=CC(=C(C=C1F)F)O

WGK 독일

3

UN 번호

2921

분자량

130.09

Beilstein

1934803

Reaxy-Rn

1934803

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1934803&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 분류 Phenols
      • Subclass Halophenols
        • Level5 Fluorophenols
          • Level6 P-fluorophenols

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: Phenols
• Subclass: Halophenols
• Intermediate Tree Nodes: Fluorophenols
• Direct Parent: P-fluorophenols
• Alternative Parents: O-fluorophenols Fluorobenzenes 1-hydroxy-2-unsubstituted benzenoids Aryl fluorides Organooxygen compounds Organofluorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: 4-fluorophenol - 2-fluorophenol - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - Fluorobenzene - Monocyclic benzene moiety - Aryl halide - Aryl fluoride - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organofluoride - Organohalogen compound - Aromatic homomonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as p-fluorophenols. These are fluorophenols carrying a iodine at the C4 position of the benzene ring.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

작용 메커니즘

화학 및 물리적 특성

• 굴절률: 1.486
• 발화점(°F): 134.6 °F
• 발화점(°C): 56°(132°F)
• 끓는점(°C): 52-54°/14mmHg
• 녹는점(°C): 22.4°C
• 분자량: 130.090 g/mol
• XLogP3: 2.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 130.023 Da
• Monoisotopic Mass: 130.023 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 97.100
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1